2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine

C12H20N2 — CID 79101094

IUPAC2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine
SMILESCc1ccc(C)n1NC1CCCC1C
InChIInChI=1S/C12H20N2/c1-9-5-4-6-12(9)13-14-10(2)7-8-11(14)3/h7-9,12-13H,4-6H2,1-3H3
InChIKeyVUSNZCVURKLMFJ-UHFFFAOYSA-N
MW192.31 g/mol
LogP2.84
Rot. Bonds2

About 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine

2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine (PubChem CID 79101094) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine.

Molecular Properties

Compound Name2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine
PubChem CID79101094
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine
SMILESCc1ccc(C)n1NC1CCCC1C
InChIInChI=1S/C12H20N2/c1-9-5-4-6-12(9)13-14-10(2)7-8-11(14)3/h7-9,12-13H,4-6H2,1-3H3
InChIKeyVUSNZCVURKLMFJ-UHFFFAOYSA-N
XLogP2.84
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine?
The IUPAC name of 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine (CID 79101094) is 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine.
What is the SMILES notation for 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine?
The canonical SMILES for 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine is Cc1ccc(C)n1NC1CCCC1C.
What is the InChIKey of 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine?
The InChIKey is VUSNZCVURKLMFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-9-5-4-6-12(9)13-14-10(2)7-8-11(14)3/h7-9,12-13H,4-6H2,1-3H3.
What are the key properties of 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine?
2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine has a molecular weight of 192.31 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-(2-methylcyclopentyl)pyrrol-1-amine is sourced from PubChem (CID 79101094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).